SCHEMBL334018

SCHEMBL334018

Cc1ccc(C(=O)O)c(Oc2ccc3c(c2)c(C(=O)O)c(CC(=O)O)n3-c2ccc(OC(C)C)cc2)n1

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
KDM4E B2RXH2 2/20 0.38
PTGES O14684 3/20 0.37
GAA P10253 1/20 0.36
ALDH1A1 P00352 2/20 0.36
POLB P06746 1/20 0.34
MAPT P10636 4/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
NPSR1 Q6W5P4 1/20 0.34
THRB P10828 1/20 0.34
HTT P42858 1/20 0.33
USP14 P54578 1/20 0.33
PLA2G4A P47712 1/20 0.33
TP53 P04637 1/20 0.33

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL333871 0.94 MEN1 (0.37) MEN1KMT2AKDM4EPTGESGAA
SCHEMBL334068 0.86 MEN1 (0.39) MEN1KMT2AKDM4EPTGESGAA
SCHEMBL333231 0.82 MEN1 (0.48) MEN1KMT2AKDM4EPTGESGAA
SCHEMBL503872 0.81 USP14 (0.48) MEN1KMT2AKDM4EPTGESGAA
SCHEMBL334235 0.81 BCL2 (0.42) MEN1KMT2AKDM4EPTGESGAA
SCHEMBL333916 0.81 THRB (0.41) MEN1KMT2AKDM4EGAAALDH1A1
SCHEMBL5506893 0.81 RAB9A (0.40) MEN1KMT2AKDM4E
SCHEMBL334002 0.80 SMN1; SMN2 (0.43) MEN1KMT2AKDM4EPOLBMAPT
SCHEMBL3003071 0.79 GAA (0.48) MEN1KMT2AKDM4EPTGESGAA
SCHEMBL334350 0.79 PTGES (0.52) MEN1KMT2AKDM4EPTGES

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8097623-B2 1-Aryl-or heteroaryl-3-aryl-or heteroarylindole-2-carboxylic acids or esters: e.g., 5-(4-tert-Butylphenyl)-1,3-bis(4-isopropoxyphenyl)-indole-2-carboxylic acid; inhibition of the activity of microsomal prostaglandin E synthase-1, leukotriene C4 and/or 5-lipoxygenase-activating protein; analgesics BIOLIPOX AB (SE) 2012-01-17 US disclosed
EP-1841735-B1 INDOLES USEFUL IN THE TREATMENT OF INFLAMMATION BIOLIPOX AB (SE) 2011-03-09 EP disclosed
US-20090076004-A1 Indoles Useful in the Treatment of Inflammation BIOLIPOX AB (SE) 2009-03-19 US disclosed
EP-1841735-A1 INDOLES USEFUL IN THE TREATMENT OF INFLAMMATION Biolipox AB (SE) 2007-10-10 EP disclosed
WO-2006077366-A1 INDOLES USEFUL IN THE TREATMENT OF INFLAMMATION BIOLIPOX AB (SE) 2006-07-27 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090076004-A1 Indoles Useful in the Treatment of Inflammation IDO1, IDO2, AREG MEN1 2066/4885KMT2A 3484/4885KDM4E 1104/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.